4-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]-4-oxo-butanoic acid CAS Name: 4-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]-4-oxobutanoic acid IUPAC Name: 4-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]-4-oxobutanoic acid Traditional Name: 4-keto-4-[3-[1-(2-methylcyclopropyl)butylamino]phenyl]butyric acid Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CC1C)NC2=CC=CC(=C2)C(=O)CCC(=O)O

Isomeric SMILES

CCCC(C1CC1C)NC2=CC=CC(=C2)C(=O)CCC(=O)O

InChI

InChI=1S/C18H25NO3/c1-3-5-16(15-10-12(15)2)19-14-7-4-6-13(11-14)17(20)8-9-18(21)22/h4,6-7,11-12,15-16,19H,3,5,8-10H2,1-2H3,(H,21,22)